Information card for entry 2224552

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>'-[(2-Hydroxy-1-naphthyl)methylene]benzohydrazide monohydrate
• Formula: C18 H16 N2 O3
• Calculated formula: C18 H16 N2 O3
• SMILES: N(/N=C/c1c(O)ccc2c1cccc2)C(=O)c1ccccc1.O
• Title of publication: (<i>E</i>)-<i>N</i>'-[(2-Hydroxy-1-naphthyl)methylene]benzohydrazide monohydrate
• Authors of publication: Qiao, Yan; Ju, Xiuping; Gao, Zhiqing; Kong, Lingqian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 1
• Pages of publication: o95
• a: 16.346 ± 0.006 Å
• b: 7.192 ± 0.003 Å
• c: 13.88 ± 0.005 Å
• α: 90°
• β: 111.949 ± 0.004°
• γ: 90°
• Cell volume: 1513.5 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0845
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.1121
• Weighted residual factors for all reflections included in the refinement: 0.1476
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes